BO3CM2 -OEChem-04022103253D 51 54 0 0 0 0 0 0 0999 V2000 -4.4958 -2.4005 0.9423 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.6072 -3.1098 -0.3150 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6414 -3.7363 0.4975 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5071 -3.9199 -0.8195 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0367 2.2889 2.3346 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3277 3.8754 -0.6208 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0866 1.3386 2.5621 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3512 -2.3172 -1.6332 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2502 0.1118 0.1594 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3373 0.3963 0.7210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0697 -0.2764 1.0231 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9192 -1.7778 0.5831 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8467 0.3313 2.0117 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6176 -1.3514 0.2954 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1816 0.4008 1.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6715 -1.1525 1.5755 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1492 -0.0842 2.3103 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4081 -1.3249 -1.3906 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1406 1.3884 1.9574 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8550 0.0576 -1.1865 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6798 0.4415 -1.8325 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5170 0.9567 -0.3505 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1667 1.7245 -1.6426 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0040 2.2399 -0.1607 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8289 2.6238 -0.8067 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4181 0.1049 -0.1287 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0322 -1.1474 -0.1175 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8750 1.0980 -0.9951 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1221 4.2011 -1.3112 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1033 -1.4065 -0.9727 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9460 0.8387 -1.8503 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5602 -0.4135 -1.8392 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0269 -1.8275 -0.4817 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6829 -1.4818 1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7361 0.4030 3.0817 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3929 1.9517 3.3048 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8901 -2.3087 -2.5507 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0711 -1.3136 -2.2634 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0165 -1.6356 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1489 -0.2264 -2.5043 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4336 0.6697 0.1579 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2516 1.9577 -2.1762 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5236 2.9356 0.4924 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6488 2.8255 3.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4045 2.0778 -1.0115 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 3.5720 -0.9818 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 4.1728 -2.3974 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8674 5.2329 -1.0478 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5929 -2.3771 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3019 1.6120 -2.5249 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3941 -0.6152 -2.5051 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 8 1 0 0 0 0 2 12 1 0 0 0 0 5 19 1 0 0 0 0 5 44 1 0 0 0 0 6 25 1 0 0 0 0 6 29 1 0 0 0 0 7 13 1 0 0 0 0 7 19 1 0 0 0 0 7 36 1 0 0 0 0 8 18 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 26 1 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 12 14 2 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 14 33 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 18 20 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 40 1 0 0 0 0 22 24 2 0 0 0 0 22 41 1 0 0 0 0 23 25 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 27 30 2 0 0 0 0 28 31 1 0 0 0 0 28 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 30 32 1 0 0 0 0 30 49 1 0 0 0 0 31 32 2 0 0 0 0 31 50 1 0 0 0 0 32 51 1 0 0 0 0 M END $$$$